!  def2-TZVP AutoAux printbasis DLPNO-CCSD(T) TightSCF
%pal nprocs 24
end

%maxcore 5000

* xyz 0 1
 C	-2.534356000	 0.599563000	 2.350249000
 H	-2.041334000	 1.223588000	 3.093094000
 H	-3.437982000	 0.142360000	 2.748905000
 C	-2.699618000	 1.228429000	 1.035219000
 C	-3.815454000	 1.069233000	 0.296441000
 H	-4.607803000	 0.443086000	 0.707918000
 H	-1.869463000	 1.833990000	 0.680872000
 Br	-1.193342000	-1.026744000	 2.242592000
 C	-4.109521000	 1.655555000	-1.013375000
 C	-3.170748000	 2.402305000	-1.753514000
 C	-5.389047000	 1.460900000	-1.566953000
 C	-3.506616000	 2.935661000	-2.993791000
 H	-2.170660000	 2.558709000	-1.361656000
 C	-5.725052000	 1.996413000	-2.809115000
 H	-6.124240000	 0.883105000	-1.012518000
 C	-4.784913000	 2.737296000	-3.527247000
 H	-2.768494000	 3.505799000	-3.550725000
 H	-6.718864000	 1.834028000	-3.216304000
 H	-5.042288000	 3.154523000	-4.496433000
*


